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4'-Hydroxy-3'-methoxyacetophenone, 3-methylbutyl ether
SpectraBase Compound ID LMtxe0kMMTw
InChI InChI=1S/C14H20O3/c1-10(2)7-8-17-13-6-5-12(11(3)15)9-14(13)16-4/h5-6,9-10H,7-8H2,1-4H3
InChIKey SZTDWEVOYCSIQB-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J8rHFqtKJTU
Name 4'-Hydroxy-3'-methoxyacetophenone, 3-methylbutyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 236.141244501 u
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-10(2)7-8-17-13-6-5-12(11(3)15)9-14(13)16-4/h5-6,9-10H,7-8H2,1-4H3
InChIKey SZTDWEVOYCSIQB-UHFFFAOYSA-N
Molecular Weight 236.311 g/mol
SMILES C1(=CC(OC)=C(C=C1)OCCC(C)C)C(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971397